4-(acetamidomethyl)-7-azanyl-4a,5,8,8a-tetrahydronaphthalene-2-sulfonic acid

Systemtic Name: 4-(acetamidomethyl)-7-azanyl-4a,5,8,8a-tetrahydronaphthalene-2-sulfonic acid Openeye Name: 4-(acetamidomethyl)-7-amino-4a,5,8,8a-tetrahydronaphthalene-2-sulfonic acid CAS Name: 4-(acetamidomethyl)-7-amino-4a,5,8,8a-tetrahydronaphthalene-2-sulfonic acid IUPAC Name: 4-(acetamidomethyl)-7-amino-4a,5,8,8a-tetrahydronaphthalene-2-sulfonic acid Traditional Name: 4-(acetamidomethyl)-7-amino-4a,5,8,8a-tetrahydronaphthalene-2-sulfonic acid Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC(=CC2C1CC=C(C2)N)S(=O)(=O)O

Isomeric SMILES

CC(=O)NCC1=CC(=CC2C1CC=C(C2)N)S(=O)(=O)O

InChI

InChI=1S/C13H18N2O4S/c1-8(16)15-7-10-6-12(20(17,18)19)5-9-4-11(14)2-3-13(9)10/h2,5-6,9,13H,3-4,7,14H2,1H3,(H,15,16)(H,17,18,19)